Monomers
Ethyl 2-chloroacrylate
Identifiers
IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.302
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
15 14 0 0 0 0 0 0 0 0999 V2000
-2.3031 -0.2607 -0.3486 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2263 -0.2284 -1.3813 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0421 0.3893 -0.9703 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7403 -0.0192 0.0956 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3168 -1.0414 0.7281 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9631 0.6415 0.4976 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6614 0.2109 1.5132 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5102 2.0356 -0.3911 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.9818 -1.1207 -0.5945 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9404 0.6583 -0.3996 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9455 -0.4560 0.6805 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6208 0.3849 -2.2436 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0145 -1.2254 -1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5698 0.6827 1.8304 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3129 -0.6514 2.0543 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers